ChemSpider 2D Image | 2-Bromo-5-(3-methoxyphenoxy)-1,3,4-thiadiazole | C9H7BrN2O2S

2-Bromo-5-(3-methoxyphenoxy)-1,3,4-thiadiazole

  • Molecular FormulaC9H7BrN2O2S
  • Average mass287.133 Da
  • Monoisotopic mass285.941162 Da
  • ChemSpider ID29738887

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

1,3,4-Thiadiazole, 2-bromo-5-(3-methoxyphenoxy)- [ACD/Index Name]
2-Brom-5-(3-methoxyphenoxy)-1,3,4-thiadiazol [German] [ACD/IUPAC Name]
2-Bromo-5-(3-methoxyphenoxy)-1,3,4-thiadiazole [ACD/IUPAC Name]
2-Bromo-5-(3-méthoxyphénoxy)-1,3,4-thiadiazole [French] [ACD/IUPAC Name]
1344306-45-1 [RN]
97%
bromomethoxyphenoxythiadiazole
MFCD20368314 [MDL number]

    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.6±0.1 g/cm3
    Boiling Point: 386.4±44.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 61.0±3.0 kJ/mol
    Flash Point: 187.5±28.4 °C
    Index of Refraction: 1.617
    Molar Refractivity: 61.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 3.64
    ACD/LogD (pH 5.5): 3.13
    ACD/BCF (pH 5.5): 141.93
    ACD/KOC (pH 5.5): 1207.98
    ACD/LogD (pH 7.4): 3.13
    ACD/BCF (pH 7.4): 141.93
    ACD/KOC (pH 7.4): 1207.98
    Polar Surface Area: 72 Å2
    Polarizability: 24.4±0.5 10-24cm3
    Surface Tension: 53.8±3.0 dyne/cm
    Molar Volume: 176.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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